Compile Data Set for Download or QSAR

Found 1 hit of ki data for polymerid = 50004548   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Deoxyribonuclease-2-alpha (Homo sapiens (Human))	BDBM50326048 ((2R,5S,8S,11S,14S,17S,20S,23S,26S,29S,32S,35R)-8,1...) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(O)=O |r,wU:98.103,51.50,8.8,15.14,76.78,34.33,wD:4.4,65.66,26.25,84.86,103.107,42.41,(.31,-40.62,;.28,-39.08,;1.6,-38.28,;-1.07,-38.34,;-1.09,-36.79,;-2.44,-36.06,;-3.77,-36.84,;-3.74,-38.38,;-5.12,-36.1,;-6.42,-36.89,;-5.16,-34.55,;-3.84,-33.76,;.22,-36,;.19,-34.46,;1.57,-36.74,;2.88,-35.94,;2.85,-34.4,;4.18,-33.6,;4.14,-32.07,;5.46,-31.27,;5.43,-29.73,;4.07,-28.99,;6.76,-28.94,;4.24,-36.68,;4.27,-38.22,;5.56,-35.89,;6.91,-36.63,;6.94,-38.17,;8.29,-38.91,;8.32,-40.45,;9.61,-38.12,;8.23,-35.84,;8.2,-34.29,;9.58,-36.58,;10.9,-35.78,;10.86,-34.24,;12.18,-33.45,;12.15,-31.91,;13.53,-34.19,;12.24,-36.52,;12.27,-38.06,;13.56,-35.73,;14.91,-36.47,;14.94,-38.01,;16.28,-38.75,;16.32,-40.29,;15,-41.08,;17.66,-41.04,;16.22,-35.67,;16.19,-34.14,;17.57,-36.42,;18.89,-35.62,;18.86,-34.08,;20.18,-33.29,;21.45,-34.16,;22.67,-33.23,;22.16,-31.78,;22.89,-30.42,;22.09,-29.1,;20.55,-29.15,;19.82,-30.5,;20.62,-31.81,;20.24,-36.36,;20.28,-37.9,;21.56,-35.56,;22.91,-36.3,;22.94,-37.84,;24.29,-38.58,;25.61,-37.79,;26.96,-38.53,;26.99,-40.07,;25.67,-40.87,;24.33,-40.12,;24.23,-35.51,;24.19,-33.97,;25.58,-36.24,;26.9,-35.46,;26.87,-33.91,;28.19,-33.12,;28.16,-31.58,;29.53,-33.86,;28.25,-36.2,;28.28,-37.73,;29.56,-35.39,;30.91,-36.14,;30.94,-37.68,;32.29,-38.42,;33.53,-37.52,;34.78,-38.42,;34.3,-39.89,;35.06,-41.23,;34.29,-42.56,;32.75,-42.55,;31.98,-41.21,;32.76,-39.89,;32.23,-35.34,;32.2,-33.81,;33.58,-36.08,;34.9,-35.29,;34.87,-33.75,;36.25,-36.03,;36.29,-37.57,;37.57,-35.23,;38.92,-35.97,;38.95,-37.51,;40.3,-38.25,;40.24,-35.18,;41.59,-35.92,;40.21,-33.64,)| Show InChI InChI=1S/C75H110N18O14S2/c1-39(2)28-54(86-64(96)49(76)37-108)68(100)84-52(24-17-27-80-75(78)79)65(97)87-56(30-41(5)6)70(102)88-55(29-40(3)4)69(101)85-53(25-26-62(77)94)66(98)91-60(34-46-36-82-51-23-16-14-21-48(46)51)73(105)90-58(32-44-18-11-10-12-19-44)72(104)89-57(31-42(7)8)71(103)92-59(33-45-35-81-50-22-15-13-20-47(45)50)67(99)83-43(9)63(95)93-61(38-109)74(106)107/h10-16,18-23,35-36,39-43,49,52-61,81-82,108-109H,17,24-34,37-38,76H2,1-9H3,(H2,77,94)(H,83,99)(H,84,100)(H,85,101)(H,86,96)(H,87,97)(H,88,102)(H,89,104)(H,90,105)(H,91,98)(H,92,103)(H,93,95)(H,106,107)(H4,78,79,80)/t43-,49-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Molecular Biology, Medical Research Council Curated by ChEMBL					Assay Description Binding affinity to Dnase 2				Nat Chem Biol 5: 502-7 (2009) Article DOI: 10.1038/nchembio.184 BindingDB Entry DOI: 10.7270/Q2Z60P9P
					More data for this Ligand-Target Pair